SCHEMBL3203459

SCHEMBL3203459

CCCCCCCCS(=O)(=O)OS(c1ccccc1)(c1ccccc1)c1ccc(CC)cc1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.41
ABCB1 P08183 4/20 0.40
ABCC1 P33527 3/20 0.39
CA2 P00918 2/20 0.39
ALDH1A1 P00352 3/20 0.38
MAPT P10636 2/20 0.38
KDM4E B2RXH2 1/20 0.38
F2 P00734 1/20 0.38
VDR P11473 1/20 0.38
MMP1 P03956 1/20 0.36
MMP9 P14780 1/20 0.36
MMP13 P45452 1/20 0.36
TSHR P16473 1/20 0.36
PTGS2 P35354 1/20 0.36
TAS2R14 Q9NYV8 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL453414 0.91 TDP1 (0.47) TDP1ABCB1ABCC1ALDH1A1MMP1
SCHEMBL1664176 0.91 TDP1 (0.47) TDP1ABCB1ABCC1ALDH1A1MMP1
SCHEMBL3193368 0.87 MCHR1 (0.43) TDP1ABCB1ABCC1ALDH1A1MAPT
SCHEMBL562842 0.85 TDP1 (0.50) TDP1ABCB1ABCC1ALDH1A1MMP1
SCHEMBL3190153 0.85 PTGS2 (0.44) TDP1ALDH1A1MAPTMMP1MMP9
SCHEMBL450158 0.84 ALDH1A1 (0.40) TDP1ABCB1ABCC1ALDH1A1MAPT
SCHEMBL3191672 0.82 TSHR (0.39) TDP1ABCB1ABCC1CA2ALDH1A1
SCHEMBL15676099 0.80 ESR1 (0.46) ALDH1A1MAPTKDM4EPTGS2
SCHEMBL6652822 0.78 TDP1 (0.49) TDP1ABCB1CA2ALDH1A1MAPT
SCHEMBL17222453 0.78 TDP1 (0.39) TDP1ABCB1ABCC1ALDH1A1MAPT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8206888-B2 Radiation-sensitive resin composition JSR CORPORATION (JP) 2012-06-26 US disclosed
US-20100028800-A1 RADIATION-SENSITIVE RESIN COMPOSITION JSR CORPORATION (JP) 2010-02-04 US disclosed
EP-1953593-A1 RADIATION-SENSITIVE RESIN COMPOSITION JSR Corporation (JP) 2008-08-06 EP disclosed
US-7060414-B2 Radiation-sensitive resin composition JSR CORPORATION (JP) 2006-06-13 US disclosed
US-20050158657-A1 Radiation-sensitive resin composition SUZUKI AKI (JP) 2005-07-21 US disclosed
US-6899989-B2 Radiation-sensitive resin composition JSR CORPORATION (JP) 2005-05-31 US disclosed
US-20020090569-A1 Radiation-sensitive resin composition JSR CORPORATION (JP) 2002-07-11 US disclosed